NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.3885 8.1876 121.9742 56.0138 30.7204 173.6069 16 N 5.4044 8.3461 121.8977 50.8943 40.5755 171.7353 17 Y 4.8280 8.8864 117.2738 55.7901 42.9847 176.0701 18 L 4.5001 8.7204 123.9557 56.0139 43.5706 175.7901 19 F 4.9404 8.4788 121.5003 57.4285 42.5837 172.7458 20 G 3.8419 7.6452 110.8504 45.3008 0.0000 171.9013 21 C 4.4969 8.0861 115.6899 56.2665 33.4494 172.1559 22 E 5.0401 8.5165 121.2769 54.5093 31.5655 174.6861 23 L 4.7368 8.9531 127.4504 53.1748 43.7804 175.6452 24 K 5.0129 8.5170 122.4410 53.8585 35.7571 175.4035 25 A 3.8269 8.2282 125.1390 53.4155 18.7966 177.3539 26 D 4.5178 9.0153 121.6112 55.1439 37.9515 173.8275 27 K 4.6797 7.6850 116.6062 54.6980 35.3949 174.7446 28 D 5.0855 8.5197 123.0611 52.6750 44.0807 175.0438 29 Y 4.5112 9.2647 123.3855 56.2419 40.9361 174.1728 30 H 4.6613 8.1314 124.7379 54.8588 30.0614 174.7435 31 F 4.7756 9.4533 127.0930 56.2376 41.1257 173.9536 32 K 4.6399 7.8093 124.2074 54.9939 35.7955 175.7685 33 V 4.1779 8.0511 120.9215 61.1007 33.9316 175.5200 34 D 4.5484 8.0708 125.6570 51.1181 39.0695 174.3313 *39 E 4.0660 7.9129 125.5140 57.1485 31.0418 174.6429 40 H 4.3877 7.8684 115.9714 54.9761 30.1438 173.9956 41 Q 4.6631 9.2084 121.6277 54.6359 33.1065 173.2596 42 L 4.7975 8.6905 127.3402 53.4304 44.5412 174.9475 43 S 5.0425 9.0475 123.3306 57.1821 63.9092 172.6923 44 L 4.5232 10.7076 127.9009 55.2473 42.6917 175.7306 45 R 4.3924 9.7822 125.2217 56.2486 30.5336 176.7635 46 T 5.0127 6.3217 110.5737 60.5434 73.0052 175.2909 47 V 4.7739 8.7219 122.1325 61.4860 34.3426 174.3324 48 S 5.1832 8.9660 124.3804 56.4466 66.5266 174.1047 49 L 4.0702 8.4167 124.0943 54.6037 42.6429 177.3241 50 G 3.7947 8.8230 110.0460 45.2950 0.0000 174.6651 51 A 4.1692 8.7037 122.4353 54.4941 18.4032 178.7990 52 G 3.8427 7.8450 101.6453 45.2194 0.0000 173.7416 53 A 4.5871 7.0260 121.2078 51.7069 18.8993 177.4392 54 K 4.3950 7.7681 119.2744 55.5749 33.3992 177.5858 55 D 4.6300 8.4537 121.2670 54.3617 40.4406 175.1030 56 E 4.6155 7.6745 115.8222 53.7474 32.4624 174.8899 57 L 4.3321 8.2391 121.3678 55.5119 42.6946 175.5238 58 H 5.0961 9.3980 123.3294 54.1245 31.9827 172.5567 59 I 5.0806 8.4445 124.1887 59.4237 40.1002 174.6772 60 V 4.6652 8.8805 127.5208 61.3037 33.3031 174.0255 61 E 5.2394 9.6113 129.2288 54.5506 32.2448 174.2245 62 A 5.1045 8.9741 126.6815 50.0093 22.8075 174.5864 63 E 5.4095 9.8641 122.9454 53.7154 32.1223 174.5572 64 A 5.0104 8.2632 127.2823 50.6338 22.8048 175.0527 65 M 4.5956 8.6547 117.6676 55.5272 32.4225 176.3485 66 N 4.8737 8.5024 118.7078 51.8396 39.8078 173.4425 67 Y 4.2964 8.4951 117.8091 61.6221 39.4711 179.5755 68 E 4.0364 8.1153 120.7505 56.2401 28.3696 180.1112 69 G 3.8960 7.9112 109.8250 47.1955 0.0000 174.2103 70 S 4.6448 8.4236 114.3001 56.6555 64.6049 172.7946 71 P 4.9778 0.0000 0.0000 63.5747 32.2806 174.7243 72 I 4.4935 8.1727 112.9415 60.3187 41.4314 173.0036 73 K 5.1142 8.5782 121.6200 54.6653 34.3047 176.0243 74 V 4.5456 8.7843 123.6822 61.3911 35.5444 174.1704 75 T 4.8107 8.3978 121.2779 62.4709 68.9693 174.6257 76 L 4.4230 9.0137 127.7605 57.2593 42.5070 177.3049 77 A 4.6667 7.6804 117.5807 51.1321 22.7884 175.2352 78 T 4.9931 8.5352 116.2418 61.9822 70.9545 173.5499 79 L 4.9323 9.2142 126.8965 52.8605 46.1713 175.7702 80 K 4.2448 8.6376 116.0100 56.6123 35.3498 175.1798 81 M 3.7622 9.1408 128.9606 58.7602 32.1995 177.0255 82 S 4.6094 8.0829 109.7196 58.2887 63.6833 173.8979 83 V 4.1735 7.4964 118.5295 64.3607 33.0927 176.2971 84 Q 4.5259 8.5470 124.4006 54.5458 30.3123 172.2784 85 P 4.3634 0.0000 0.0000 64.5041 32.7660 176.1428 86 T 5.1280 7.8353 114.0835 61.5409 71.8801 173.8831 87 V 4.4130 8.7397 124.9039 61.1103 34.7074 173.8564 88 S 5.0493 8.6982 122.3849 56.9613 63.0776 173.6476 89 L 4.1925 9.4973 128.2444 55.1950 42.2417 178.3743 90 G 3.7753 8.0484 105.7543 45.3679 0.0000 173.7639 91 G 4.3744 8.0822 106.9961 46.6039 0.0000 174.8802 92 F 4.6595 9.1288 122.2656 57.5541 40.6984 174.7943 93 E 5.8727 9.0409 124.3508 54.2317 32.0839 175.4423 94 I 4.8059 7.9457 121.4602 59.8590 41.8233 174.3573 95 T 4.5516 8.6117 122.9237 62.3751 68.9354 173.2261 96 P 4.4587 0.0000 0.0000 62.0844 32.1038 174.2026 97 P 4.9453 0.0000 0.0000 62.7015 32.8012 175.7268 98 V 4.8576 8.9872 120.1202 60.3170 35.3378 173.9424 99 V 4.8471 9.0052 123.1333 61.2010 34.1911 173.9325 100 L 5.3470 9.2674 128.4214 53.2171 44.0398 175.7487 101 R 4.8765 8.9074 118.6288 55.2247 33.4612 173.5234 102 L 4.7929 8.3448 120.0043 53.8459 42.1851 176.9527 103 K 4.3507 9.1591 125.9269 58.3816 33.2979 176.4759 104 C 4.5881 7.9318 111.6707 58.2951 32.3942 173.0637 105 G 4.0888 9.3567 111.2883 44.5151 0.0000 173.5892 106 S 4.0940 10.6706 120.9211 61.3864 63.3931 175.4246 107 G 4.0127 8.3111 107.7602 42.6263 0.0000 170.3430 108 P 5.0014 0.0000 0.0000 62.7340 33.2326 175.5167 109 V 4.6023 8.3963 120.1424 61.5065 34.2539 174.5256 110 H 5.1666 9.6729 126.4516 55.5760 30.5373 174.5461 111 I 5.1917 8.3701 120.7876 59.9500 41.7967 174.4262 112 S 4.5880 8.9365 118.7813 56.3328 66.7589 173.8869 113 G 4.2134 7.0998 106.2711 46.2177 0.0000 171.6275 114 Q 4.8793 8.7422 119.8817 54.9114 32.9926 174.4794 115 H 5.0448 9.6314 121.8302 55.0638 31.2100 173.6518 116 L 5.0518 9.5317 128.3233 53.7375 42.7665 176.3970 117 V 4.6868 8.9538 123.8858 61.3472 34.8193 175.4206 118 A 4.1429 7.7636 126.1524 52.7727 19.1071 177.5332 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 15 Q 8.19 4.39 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 16 N 8.35 5.40 0.00 2.77 2.69 0.00 0.00 5.87 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Y 8.89 4.83 0.00 3.09 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.72 4.50 0.00 1.74 1.67 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.48 4.94 0.00 3.11 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.65 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.09 4.50 0.00 1.52 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.52 5.04 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 23 L 8.95 4.74 0.00 1.70 1.58 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.52 5.01 0.00 1.70 1.68 0.00 1.71 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.41 7.81 25 A 8.23 3.83 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 D 9.02 4.52 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 7.68 4.68 0.00 1.73 1.66 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.41 7.81 28 D 8.52 5.09 0.00 2.48 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 9.26 4.51 0.00 3.10 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 H 8.13 4.66 0.00 2.88 3.07 0.00 5.70 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.45 4.78 0.00 3.25 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.81 4.64 0.00 1.57 1.55 0.00 1.44 0.00 0.00 1.51 0.00 0.00 2.73 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.09 1.23 7.81 33 V 8.05 4.18 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.43 0.00 0.00 34 D 8.07 4.55 0.00 2.71 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *39 E 7.91 4.07 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 40 H 7.87 4.39 0.00 3.22 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 9.21 4.66 0.00 2.18 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 42 L 8.69 4.80 0.00 1.68 1.67 -0.95 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 43 S 9.05 5.04 0.00 3.97 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 10.71 4.52 0.00 1.79 1.61 0.74 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 45 R 9.78 4.39 0.00 1.84 1.74 0.00 3.28 0.00 0.00 3.25 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 46 T 6.32 5.01 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 47 V 8.72 4.77 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 48 S 8.97 5.18 0.00 3.74 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.42 4.07 0.00 1.48 1.47 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.70 4.17 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.84 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.03 4.59 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.77 4.40 0.00 1.89 1.76 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.38 7.81 55 D 8.45 4.63 0.00 2.62 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.67 4.62 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 57 L 8.24 4.33 0.00 1.65 1.60 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 58 H 9.40 5.10 0.00 3.05 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.44 5.08 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.71 0.92 0.00 0.00 60 V 8.88 4.67 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.94 0.00 0.00 61 E 9.61 5.24 0.00 2.04 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 62 A 8.97 5.10 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.86 5.41 0.00 2.08 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.07 0.00 64 A 8.26 5.01 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 M 8.65 4.60 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 66 N 8.50 4.87 0.00 2.90 2.96 0.00 0.00 6.86 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.50 4.30 0.00 2.86 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.12 4.04 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 69 G 7.91 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.42 4.64 0.00 3.88 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.98 0.00 2.11 2.11 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 72 I 8.17 4.49 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.36 0.94 0.00 0.00 73 K 8.58 5.11 0.00 1.64 1.85 0.00 1.98 0.00 0.00 1.76 0.00 0.00 2.68 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.40 7.81 74 V 8.78 4.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.97 0.00 0.00 75 T 8.40 4.81 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 76 L 9.01 4.42 0.00 1.51 1.73 0.83 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.68 4.67 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.54 4.99 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 79 L 9.21 4.93 0.00 1.41 1.67 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.64 4.24 0.00 1.75 1.62 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.40 7.81 81 M 9.14 3.76 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.63 0.00 82 S 8.08 4.61 0.00 4.05 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 7.50 4.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.93 0.00 0.00 84 Q 8.55 4.53 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 85 P 0.00 4.36 0.00 2.10 2.06 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.32 0.00 86 T 7.84 5.13 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 87 V 8.74 4.41 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.94 0.00 0.00 88 S 8.70 5.05 0.00 3.91 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 9.50 4.19 0.00 1.88 1.94 1.02 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.05 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 G 8.08 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 F 9.13 4.66 0.00 3.12 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 E 9.04 5.87 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.23 0.00 94 I 7.95 4.81 1.85 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.15 0.93 0.00 0.00 95 T 8.61 4.55 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 96 P 0.00 4.46 0.00 2.02 1.92 0.00 3.85 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.34 0.00 97 P 0.00 4.95 0.00 2.06 1.99 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 98 V 8.99 4.86 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 99 V 9.01 4.85 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.98 0.00 0.00 100 L 9.27 5.35 0.00 1.85 1.63 1.12 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.91 4.88 0.00 1.85 2.10 0.00 3.09 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 102 L 8.34 4.79 0.00 1.55 1.65 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 103 K 9.16 4.35 0.00 1.73 1.96 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.38 7.81 104 C 7.93 4.59 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 9.36 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 10.67 4.09 0.00 4.03 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.31 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 5.00 0.00 2.03 2.22 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 109 V 8.40 4.60 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.89 0.00 0.00 110 H 9.67 5.17 0.00 3.03 3.05 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.37 5.19 1.66 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.57 0.89 0.00 0.00 112 S 8.94 4.59 0.00 3.73 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.10 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 8.74 4.88 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.73 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 115 H 9.63 5.04 0.00 3.35 3.51 0.00 5.76 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 9.53 5.05 0.00 1.79 1.64 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.95 4.69 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.97 0.00 0.00 118 A 7.76 4.14 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.